SCHEMBL7299202

SCHEMBL7299202

CCN(CC)C(=O)c1ccc(C)c(C)c1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.45
TSHR P16473 3/20 0.43
MAPK1 P28482 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
HSP90AA1 P07900 4/20 0.40
HSP90AB1 P08238 4/20 0.40
KEAP1 Q14145 1/20 0.39
ALDH1A1 P00352 4/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.38
TP53 P04637 2/20 0.37
MLYCD O95822 1/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KDM4A O75164 1/20 0.35
USP2 O75604 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31276129 0.84 HPGD (0.49) HPGDTSHRMAPK1SMN1; SMN2MEN1
SCHEMBL17876999 0.77 HPGD (0.43) HPGDTSHRMAPK1SMN1; SMN2MEN1
SCHEMBL28866488 0.77 HSP90AB1 (0.43) MEN1KMT2ATDP1HSP90AB1ALDH1A1
SCHEMBL7225379 0.76 HPGD (0.49) HPGDTSHRMAPK1SMN1; SMN2MEN1
SCHEMBL13666585 0.76 HPGD (0.49) HPGDTSHRMAPK1SMN1; SMN2MEN1
SCHEMBL3048462 0.75 POLB (0.39) MEN1LMNAKMT2ATDP1HSP90AA1
SCHEMBL509012 0.75 TSHR (0.57) HPGDTSHRMAPK1SMN1; SMN2MEN1
SCHEMBL272159 0.74 ALDH1A1 (0.54) HPGDTSHRMAPK1SMN1; SMN2MEN1
SCHEMBL9890969 0.74 POLB (0.38) HPGDMAPK1SMN1; SMN2TDP1ALDH1A1
SCHEMBL1149742 0.74 KDM4E (0.48) HPGDMAPK1MEN1LMNAKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550111-B1 2-Saccharinylmethyl heterocyclic carboxylates useful as proteolytic enzyme inhibitors and pharmaceutical compositions containing them SANOFI SA (FR) 1999-04-14 EP disclosed
EP-0550111-A1 2-Saccharinylmethyl heterocyclic carboxylates useful as proteolytic enzyme inhibitors and pharmaceutical compositions containing them STERLING WINTHROP INC. (US) 1993-07-07 EP disclosed
EP-0550112-A1 2-Saccharinylmethyl aryl and aryloxy acetates useful as proteolytic enzyme inhibitors and pharmaceutical compositions contaning them STERLING WINTHROP INC. (US) 1993-07-07 EP disclosed